%chk=000004911.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004911

0 1
 S    1.174800      0.1348000      -1.433400    
 O    1.463300      -1.131700      -2.080800    
 O    1.288300       1.366500      -2.192600    
 O   -5.013300       1.062400      0.7619000    
 O   -5.039100      -1.204300      0.9289000    
 N    2.103600      0.2643000      1.3800000E-02
 C    1.846600       1.427100      0.9010000    
 C    2.359000     -0.9781000      0.7864000    
 C    3.109900       1.790800       1.677200    
 C    3.631000      -1.659700      0.2882000    
 C  -0.4846000      4.6200000E-02 -0.8211000    
 C    4.244000       2.176300      0.7399000    
 C    3.903700      -2.947700       1.049800    
 C   -1.030800      -1.191300     -0.5348000    
 C   -1.199000       1.216400     -0.6425000    
 C   -2.337900      -1.261200     -5.2700002E-02
 C   -2.506000       1.146600     -0.1604000    
 C   -3.075500     -9.2200004E-02  0.1344000    
 C   -4.438200     -0.1651000      0.6368000    
 H    1.539700       2.294100      0.3062000    
 H    1.033400       1.194200       1.597800    
 H    2.427500     -0.7929000       1.862600    
 H    1.510700      -1.661600      0.6773000    
 H    2.884900       2.645400       2.326500    
 H    3.445100      0.9847000       2.336200    
 H    3.562100      -1.885200     -0.7808000    
 H    4.487000     -0.9874000      0.4120000    
 H    4.556300       1.344800      0.1030000    
 H    3.951600       3.010500      9.3599997E-02
 H    5.116200       2.494100       1.320700    
 H    4.025500      -2.752600       2.120100    
 H    3.083000      -3.660500      0.9207000    
 H    4.822200      -3.417100      0.6837000    
 H  -0.4743000      -2.112800     -0.6737000    
 H  -0.7726000       2.189900     -0.8629000    
 H   -2.763400      -2.236000      0.1710000    
 H   -3.044100       2.081100     -2.8700000E-02
 H   -5.931600       1.002200       1.101700    


%chk=000004911-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000004911

0 1
S 1.079448 0.181616 -1.506603
O 1.359860 -1.222765 -2.280098
O 1.217169 1.640386 -2.210116
O -5.295139 1.022908 0.897467
O -5.286736 -1.300179 0.870602
N 2.298355 0.207067 -0.061224
C 2.055067 1.389626 0.808932
C 2.416428 -1.126138 0.591006
C 3.346853 1.830971 1.540599
C 3.892641 -1.574619 0.712597
C -0.706246 0.074217 -0.842595
C 4.477860 2.249230 0.580519
C 4.001322 -2.969103 1.366506
C -1.269473 -1.201347 -0.658746
C -1.389032 1.274055 -0.577424
C -2.586574 -1.273200 -0.161961
C -2.706863 1.188300 -0.080955
C -3.301220 -0.082529 0.133197
C -4.690778 -0.218527 0.655953
H 1.731546 2.218446 0.151060
H 1.252674 1.187259 1.555590
H 1.922934 -1.116487 1.588287
H 1.899641 -1.875294 -0.040849
H 3.067609 2.681404 2.194839
H 3.689938 1.022222 2.213962
H 4.330743 -1.587530 -0.301981
H 4.466496 -0.835210 1.300187
H 4.742162 1.419941 -0.097150
H 4.165238 3.102165 -0.049635
H 5.381499 2.549747 1.141213
H 3.574267 -2.972227 2.387311
H 3.464626 -3.731878 0.771880
H 5.057071 -3.284793 1.443066
H -0.706259 -2.099416 -0.931102
H -0.914879 2.237942 -0.787306
H -3.079680 -2.237631 -0.004326
H -3.282177 2.092164 0.135365
H -6.217391 0.874207 1.238930


